Geometry & MOs

Info

ID:	181396
PubChem CID:	76742736
Reduced:	F2N5O5C37H49 (1)
Stoich.:	A2B5C5D37E49 (1)
Weight, g/mol:	434.205301
ΔH_f, kcal/mol:	-258.14
Dipole, Da:	6.48
IP(EA), eV:	-8.37(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-acetyloxy-2-[4-[3-[2-(dimethylamino)-2-oxoethyl]phenyl]-3-oxomorpholin-2-yl]acetate

Drug info:

PubChemData

Smile

CC(C)(C)C(CC(=O)OC1CCCC1)C(=O)N2CN(CC2C(=O)CC3(CC3CC(F)F)C(=O)NCC4CC4)C5=CC=C(C=C5)N6C=CC=N6

DOS

IR

Vibrations